Geometry & MOs

Info

ID:	143466
PubChem CID:	53213153
Reduced:	O2N3H13C14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	255.100777
ΔH_f, kcal/mol:	31.2
Dipole, Da:	8.35
IP(EA), eV:	-9.91(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-3-(2-methylphenyl)-2H-[1,2]oxazolo[5,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=C3C(=NC=NC3=O)ON2

DOS

IR

Vibrations